dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide

C16H22Br2Mg2S2Si — CID 155899539

IUPACdimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide
SMILESCCCC[Si](CCCC)(c1cc[c-]s1)c1cc[c-]s1.[Br-].[Br-].[Mg+2].[Mg+2]
InChIInChI=1S/C16H22S2Si.2BrH.2Mg/c1-3-5-13-19(14-6-4-2,15-9-7-11-17-15)16-10-8-12-18-16;;;;/h7-10H,3-6,13-14H2,1-2H3;2*1H;;/q-2;;;2*+2/p-2
InChIKeySEMWRZVLNNNZIX-UHFFFAOYSA-L
MW514.99 g/mol
LogP-2.18
Rot. Bonds8

About dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide

dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide (PubChem CID 155899539) has the molecular formula C16H22Br2Mg2S2Si and a molecular weight of 514.99 g/mol. Its IUPAC name is dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide.

Molecular Properties

Compound Namedimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide
PubChem CID155899539
Molecular FormulaC16H22Br2Mg2S2Si
Molecular Weight514.99 g/mol
Exact Mass511.90
IUPAC Namedimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide
SMILESCCCC[Si](CCCC)(c1cc[c-]s1)c1cc[c-]s1.[Br-].[Br-].[Mg+2].[Mg+2]
InChIInChI=1S/C16H22S2Si.2BrH.2Mg/c1-3-5-13-19(14-6-4-2,15-9-7-11-17-15)16-10-8-12-18-16;;;;/h7-10H,3-6,13-14H2,1-2H3;2*1H;;/q-2;;;2*+2/p-2
InChIKeySEMWRZVLNNNZIX-UHFFFAOYSA-L
XLogP-2.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500514.99
LogP ≤ 5-2.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

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CID 139900679
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CID 19887258
2-[4-[dibutyl-[4-(cyanomethyl)phenyl]silyl]phenyl]acetonitrile
CID 100920096
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CID 54724510
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tributyl(furan-2-yl)silane
CID 12034028
[5-[5-[5-[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
CID 101486956
4-[dibutyl-(4-hydroxy-3-methylphenyl)silyl]-2-methylphenol
CID 71712305
[5-[5-[5-[dimethyl(octyl)silyl]thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]-dimethyl-octylsilane
CID 101486953
bis(3-chlorophenyl)-didodecylsilane
CID 3247729
chloro-bis(4-tributylsilylphenyl)phosphane
CID 155668506

Frequently Asked Questions

What is the IUPAC name of dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide?
The IUPAC name of dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide (CID 155899539) is dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide.
What is the SMILES notation for dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide?
The canonical SMILES for dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide is CCCC[Si](CCCC)(c1cc[c-]s1)c1cc[c-]s1.[Br-].[Br-].[Mg+2].[Mg+2].
What is the InChIKey of dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide?
The InChIKey is SEMWRZVLNNNZIX-UHFFFAOYSA-L. The full InChI is InChI=1S/C16H22S2Si.2BrH.2Mg/c1-3-5-13-19(14-6-4-2,15-9-7-11-17-15)16-10-8-12-18-16;;;;/h7-10H,3-6,13-14H2,1-2H3;2*1H;;/q-2;;;2*+2/p-2.
What are the key properties of dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide?
dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide has a molecular weight of 514.99 g/mol, XLogP of -2.18, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimagnesium;dibutyl-bis(2H-thiophen-2-id-5-yl)silane;dibromide is sourced from PubChem (CID 155899539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).